吖啶盐(NSP-AS)

pro_cas
211106-69-3
pro_cdbregno
CCD07193493
pro_formula
C28 H28 N2 O8 S2
pro_molWeight
584.667

basic_info

Product_Name: 吖啶盐(NSP-AS)
CAS: 211106-69-3
中文同义词: 吖啶盐(NSP-AS)
EnglishSynonyms: 3-[9-(((3-(CARBOXYPROPYL)[4-METHOXYLPHENYL]SULFONYL)AMINE)CARBOXYL]-10-ACRIDINIUMYL)-1-PROPANESULFONATE INNER SALT
pro_mdlNumber: MFCD22200710
pro_acceptors: 10
pro_donors: 1
pro_smile: Cc1ccc(cc1)S(=O)(=O)N(CCCC(=O)O)C(=O)c2c3ccccc3[n+](c4c2cccc4)CCCS(=O)(=O)[O-]
InChi: InChI=1S/C28H28N2O8S2/c1-20-13-15-21(16-14-20)40(37,38)30(18-6-12-26(31)32)28(33)27-22-8-2-4-10-24(22)29(17-7-19-39(34,35)36)25-11-5-3-9-23(25)27/h2-5,8-11,13-16H,6-7,12,17-19H2,1H3,(H-,31,32,34,35,36)
InChiKey: InChIKey=VYTOBATYLKBDAR-UHFFFAOYSA-N

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